ethyl 2-(1,3-benzodioxol-5-ylcarbonylamino)-4-methyl-5-(1-phenylethylcarbamoyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-(1,3-benzodioxol-5-ylcarbonylamino)-4-methyl-5-(1-phenylethylcarbamoyl)thiophene-3-carboxylate Openeye Name: ethyl 2-(1,3-benzodioxole-5-carbonylamino)-4-methyl-5-(1-phenylethylcarbamoyl)thiophene-3-carboxylate CAS Name: 2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-4-methyl-5-[oxo-(1-phenylethylamino)methyl]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(1,3-benzodioxole-5-carbonylamino)-4-methyl-5-(1-phenylethylcarbamoyl)thiophene-3-carboxylate Traditional Name: 4-methyl-5-(1-phenylethylcarbamoyl)-2-(piperonyloylamino)thiophene-3-carboxylic acid ethyl ester Formula: C25H24N2O6S MolecularWeight: 480.53286

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC(C)C2=CC=CC=C2)NC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC(C)C2=CC=CC=C2)NC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C25H24N2O6S/c1-4-31-25(30)20-14(2)21(23(29)26-15(3)16-8-6-5-7-9-16)34-24(20)27-22(28)17-10-11-18-19(12-17)33-13-32-18/h5-12,15H,4,13H2,1-3H3,(H,26,29)(H,27,28)